UCSF

ZINC20624206

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 26 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.66 5.91 -45.29 3 7 1 83 359.45 6
Hi High (pH 8-9.5) 0.66 3.63 -12.14 2 7 0 82 358.442 6

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )